Computational Chemistry LLC

Based in Madison, WI, Computational Chemistry LLC manages the Computational Chemistry Consortium (C3), an initiative that unites academia, industry, and national laboratories to innovate within combustion and emissions modeling. By focusing collaborative expertise, C3 develops precise computational chemistry mechanisms, modeling tools, and validation processes crucial to their industrial partners.

C3 operates as a members-only network for an initial three-year period, during which members have exclusive access to the developed models and tools before they are subsequently made publicly available. The consortium remains dedicated to fostering widespread usage and continuous validation of computational chemistry resources by maintaining an open mechanism format and involving the larger combustion community over the long term.

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